UCSF

ZINC39847854

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 37 No

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Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.61 8.34 -62.31 0 8 -1 91 505.591 12
Mid Mid (pH 6-8) 3.61 10.6 -76.08 1 8 0 93 506.599 12
Lo Low (pH 4.5-6) 3.61 9.85 -50.96 2 8 1 90 507.607 12

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Analogs ( Draw Identity 99% 90% 80% 70% )